SCHEMBL7897155

SCHEMBL7897155

O=C(O)C[C@@H]1CC[C@H](N2C(=O)c3ccccc3C2=O)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 3/20 0.43
TSHR P16473 2/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
CCR5 P51681 1/20 0.42
ADCY5 O95622 1/20 0.41
MEN1 O00255 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
CHRM2 P08172 2/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ALDH1A1 P00352 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
OPRM1 P35372 1/20 0.37
DDB1 Q16531 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7887316 1.00 L3MBTL1 (0.46) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL7897162 1.00 L3MBTL1 (0.46) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL7887311 1.00 L3MBTL1 (0.46) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL7887307 1.00 L3MBTL1 (0.46) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL31512221 0.92 L3MBTL1 (0.44) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL12544749 0.91 L3MBTL1 (0.51) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL2053503 0.91 L3MBTL1 (0.51) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL31512230 0.86 L3MBTL1 (0.40) L3MBTL1KMT2ATSHRCA12CA9
SCHEMBL7894554 0.80 L3MBTL1 (0.45) L3MBTL1KMT2ATSHRLMNAGAA
SCHEMBL7894556 0.80 L3MBTL1 (0.45) L3MBTL1KMT2ATSHRLMNAGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6180611-B1 INHIBITORS OF MATRIX METALLOPROTEINASES AND TUMOR NECROSIS FACTOR DARWIN DISCOVERY, LTD. (GB) 2001-01-30 US disclosed
US-5994312-A Peptidyl compounds DARWIN DISCOVERY, LTD. (GB) 1999-11-30 US disclosed